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CHEBI:42709 - [(2,2-dimethylpropanoyl)oxy]methyl (6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)pent-2-enoyl]amino}-3-[(carbamoyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
| Formula | C23H29N5O8S2 |
| Net Charge | 0 |
| Average Mass | 567.646 |
| Monoisotopic Mass | 567.14575 |
| SMILES | [H][C@]12SCC(COC(N)=O)=C(C(=O)OCOC(=O)C(C)(C)C)N1C(=O)[C@@]2([H])NC(=O)/C(=C\CC)c1csc(N)n1 |
| InChI | InChI=1S/C23H29N5O8S2/c1-5-6-12(13-9-38-21(24)26-13)16(29)27-14-17(30)28-15(11(7-34-22(25)33)8-37-18(14)28)19(31)35-10-36-20(32)23(2,3)4/h6,9,14,18H,5,7-8,10H2,1-4H3,(H2,24,26)(H2,25,33)(H,27,29)/b12-6-/t14-,18-/m1/s1 |
| InChIKey | WVPAABNYMHNFJG-QDVBXLKVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [(2,2-dimethylpropanoyl)oxy]methyl (6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)pent-2-enoyl]amino}-3-[(carbamoyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (CHEBI:42709) is a 1,3-thiazoles (CHEBI:38418) |
| [(2,2-dimethylpropanoyl)oxy]methyl (6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)pent-2-enoyl]amino}-3-[(carbamoyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (CHEBI:42709) is a cephem (CHEBI:38311) |
| Synonyms | Source |
|---|---|
| 2,2-DIMETHYLPROPANOYLOXYMETHYL (6R,7R)-7-[(Z)-2-(2-AMINOTHIAZOL-4-YL)PENT-2-ENYLAMINO]-3-CARBAMOYLOXYMETHYL-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLATE | PDBeChem |
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